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oxalic acid; tert-butyl 1,7-diazaspiro[3.5]nonane-1-carboxylate

oxalic acid; tert-butyl 1,7-diazaspiro[3.5]nonane-1-carboxylate

CAS: 1955514-54-1

Formula: C14H24N2O6

SMILES: OC(=O)C(O)=O.CC(C)(C)OC(=O)N1CCC11CCNCC1

IUPAC: oxalic acid; tert-butyl 1,7-diazaspiro[3.5]nonane-1-carboxylate

InChI: InChI=1S/C12H22N2O2.C2H2O4/c1-11(2,3)16-10(15)14-9-6-12(14)4-7-13-8-5-12;3-1(4)2(5)6/h13H,4-9H2,1-3H3;(H,3,4)(H,5,6)

Composition: C (53.15%), H (7.65%), N (8.86%), O (30.34%)

Molar Mass: 316.354

Atom Count: 46

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 316.163436501
Formal Charge 0
FSP3 0.79
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey XOAJRPVKWLHFKX-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 62.63
Topological Polar Surface Area 41.57
Polarizability 24.81
Ring Count 2
Rotatable Bond Count 3

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Purity (%)
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Purity LeadTime CAS PacketSize UnitPrice
95% 1 Day 1955514-54-1 $578.34-$2,143.26$578.34$1,054.62$2,143.26
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